N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide

C13H22N4O2S — CID 103305212

IUPACN-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCCN1CCCC(NS(=O)(=O)c2ncccc2NC)C1
InChIInChI=1S/C13H22N4O2S/c1-3-17-9-5-6-11(10-17)16-20(18,19)13-12(14-2)7-4-8-15-13/h4,7-8,11,14,16H,3,5-6,9-10H2,1-2H3
InChIKeyQDBZSGFDFRGDRW-UHFFFAOYSA-N
MW298.41 g/mol
LogP0.89
Rot. Bonds5

About N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide

N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide (PubChem CID 103305212) has the molecular formula C13H22N4O2S and a molecular weight of 298.41 g/mol. Its IUPAC name is N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide
PubChem CID103305212
Molecular FormulaC13H22N4O2S
Molecular Weight298.41 g/mol
Exact Mass298.15
IUPAC NameN-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCCN1CCCC(NS(=O)(=O)c2ncccc2NC)C1
InChIInChI=1S/C13H22N4O2S/c1-3-17-9-5-6-11(10-17)16-20(18,19)13-12(14-2)7-4-8-15-13/h4,7-8,11,14,16H,3,5-6,9-10H2,1-2H3
InChIKeyQDBZSGFDFRGDRW-UHFFFAOYSA-N
XLogP0.89
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(1-ethylpiperidin-3-yl)pyridine-2-sulfonamide
CID 103305213
N-cyclobutyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305744
N-(1-ethylpiperidin-4-yl)-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305346
N-(3,5-dimethylcyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306280
N-(1-ethylpiperidin-3-yl)-2-hydroxybenzenesulfonamide
CID 81242229
ethane;N-(1-ethylpiperidin-3-yl)benzenesulfonamide;molecular hydrogen
CID 162749983
N-(1-cyclopropylpyrrolidin-3-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103305291
N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
N-(2-hydroxycyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305739
N-(1-ethylpiperidin-3-yl)-4-hydroxybenzenesulfonamide
CID 61478239
3-bromo-N-(1-ethylpiperidin-3-yl)benzenesulfonamide
CID 47350084
N-(3-ethyl-2-methylcyclopentyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306293

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide (CID 103305212) is N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide is CCN1CCCC(NS(=O)(=O)c2ncccc2NC)C1.
What is the InChIKey of N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide?
The InChIKey is QDBZSGFDFRGDRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S/c1-3-17-9-5-6-11(10-17)16-20(18,19)13-12(14-2)7-4-8-15-13/h4,7-8,11,14,16H,3,5-6,9-10H2,1-2H3.
What are the key properties of N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide?
N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide has a molecular weight of 298.41 g/mol, XLogP of 0.89, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103305212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).